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Compile Data Set for Download or QSAR

Found 2 hits Enz. Inhib. hit(s) with Target = 'Transient receptor potential cation channel subfamily V member 1' and Ligand = 'BDBM50388090'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Transient receptor potential cation channel subfamily V member 1


(Rattus norvegicus (rat))
BDBM50388090
PNG
(CHEMBL2058155)
Show SMILES COc1cc(ccc1OCCN)C(C)NC(=S)NCc1ccc(cc1)C(C)(C)C
Show InChI InChI=1S/C23H33N3O2S/c1-16(18-8-11-20(28-13-12-24)21(14-18)27-5)26-22(29)25-15-17-6-9-19(10-7-17)23(2,3)4/h6-11,14,16H,12-13,15,24H2,1-5H3,(H2,25,26,29)
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UniProtKB/SwissProt

B.MOAD
GoogleScholar
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CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.43E+3n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H]RTX from rat TRPV1 expressed in CHO cells


Bioorg Med Chem Lett 22: 5227-31 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.059
BindingDB Entry DOI: 10.7270/Q2NS0VZB
More data for this
Ligand-Target Pair
Transient receptor potential cation channel subfamily V member 1


(Rattus norvegicus (rat))
BDBM50388090
PNG
(CHEMBL2058155)
Show SMILES COc1cc(ccc1OCCN)C(C)NC(=S)NCc1ccc(cc1)C(C)(C)C
Show InChI InChI=1S/C23H33N3O2S/c1-16(18-8-11-20(28-13-12-24)21(14-18)27-5)26-22(29)25-15-17-6-9-19(10-7-17)23(2,3)4/h6-11,14,16H,12-13,15,24H2,1-5H3,(H2,25,26,29)
PDB
MMDB

Reactome pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
n/an/an/an/a 5.80E+3n/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Agonist activity at rat TRPV1 expressed in CHO cells assessed as calcium uptake


Bioorg Med Chem Lett 22: 5227-31 (2012)


Article DOI: 10.1016/j.bmcl.2012.06.059
BindingDB Entry DOI: 10.7270/Q2NS0VZB
More data for this
Ligand-Target Pair